Vitas-M small molecule compound
ethyl 2-[({[5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK302840
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC)c2cc(nn2C)C)sc2c1CCC(C2)CC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H32N6O3S2 MW 516.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N6O3S2/c1-6-15-9-10-16-18(12-15)35-22(20(16)23(32)33-8-3)25-19(31)13-34-24-27-26-21(30(24)7-2)17-11-14(4)28-29(17)5/h11,15H,6-10,12-13H2,1-5H3,(H,25,31)InChIKey
SAVXSDGOOZTECX-UHFFFAOYSA-NSynonyms
1005556-99-91005556999
CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)CSC3=NN=C(N3CC)C4=CC(=NN4C)C
ethyl2((((5(13dimethyl1Hpyrazol5yl)4ethyl4H124triazol3yl)sulfanyl)acetyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((2((5(25dimethylpyrazol3yl)4ethyl124triazol3yl)sulfanyl)acetyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC24H32N6O3S2c16159101618(1215)3522(20(16)23(32)3383)2519(31)133424272621(30(24)72)171114(4)2829(17)5h1115H6101213H215H3(H2531)
MFCD04048709
ZINC000002743763
ZINC000002743764
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